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Carbon under extreme conditions: Phase boundaries and electronic properties from first-principles theory
ArticleAbstract: At high pressure and temperature, the phase diagram of elemental carbon is poorly known. We presentPalabras claves:High pressure, melting, Metalization, molecular dynamics, Phase transitionsAutores:Alfredo A. Correa, Bonev S.A., Galli G.Fuentes:scopusAb initio calculations of the equation of state of hydrogen in a regime relevant for inertial fusion applications
ArticleAbstract: We describe ab initio electronic structure calculations (density functional theory molecular dynamicPalabras claves:Equation of state, Fusion, hydrogenAutores:Alfredo A. Correa, Benedict L.X., Bonev S.A., Clark D.S., Haan S.W., Morales M.A., Schwegler E., Tamblyn I.Fuentes:scopusFirst-principles multiphase equation of state of carbon under extreme conditions
ArticleAbstract: We describe the construction of a multiphase equation of state for carbon at extreme pressures basedPalabras claves:Autores:Alfredo A. Correa, Benedict L.X., Bonev S.A., Schwegler E., Young D.A.Fuentes:scopus